Ethanol → HCID 57849547, compound
Reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([C:8](=[O:9])[N:10]2[CH2:11][CH:12]([c:16]3[cH:17][cH:18][cH:19][cH:20][cH:21]3)[NH:13][CH2:14][CH2:15]2)[cH:6][cH:7]1.[CH3:125][CH2:126][OH:127].[CH3:41][c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1.[F:22][C:23]([c:24]1[c:25]([B:30]([OH:31])[OH:32])[cH:26][cH:27][cH:28][cH:29]1)([F:33])[F:34].[Na+:35].[Na+:36].[O-:37][C:38](=[O:39])[O-:40].[Pd:48].[c:106]1([P:107]([c:108]2[cH:109][cH:110][cH:111][cH:112][cH:113]2)[c:114]2[cH:115][cH:116][cH:117][cH:118][cH:119]2)[cH:120][cH:121][cH:122][cH:123][cH:124]1.[c:49]1([P:50]([c:51]2[cH:52][cH:53][cH:54][cH:55][cH:56]2)[c:57]2[cH:58][cH:59][cH:60][cH:61][cH:62]2)[cH:63][cH:64][cH:65][cH:66][cH:67]1.[c:68]1([P:69]([c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)[c:76]2[cH:77][cH:78][cH:79][cH:80][cH:81]2)[cH:82][cH:83][cH:84][cH:85][cH:86]1.[c:87]1([P:88]([c:89]2[cH:90][cH:91][cH:92][cH:93][cH:94]2)[c:95]2[cH:96][cH:97][cH:98][cH:99][cH:100]2)[cH:101][cH:102][cH:103][cH:104][cH:105]1>>[c:2]1(-[c:25]2[c:24]([C:23]([F:22])([F:33])[F:34])[cH:29][cH:28][cH:27][cH:26]2)[cH:3][cH:4][c:5]([C:8](=[O:9])[N:10]2[CH2:11][CH:12]([c:16]3[cH:17][cH:18][cH:19][cH:20][cH:21]3)[NH:13][CH2:14][CH2:15]2)[cH:6][cH:7]1Participants
9
Sources & evidence
- ORD record
- ord-2555c6c8bb1840afa23f78c4c4491339
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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